Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMPD1 | P17405 | 2/20 | 0.45 |
| ▸ | CES2 | O00748 | 1/20 | 0.45 |
| ▸ | FDPS | P14324 | 1/20 | 0.45 |
| ▸ | GPR84 | Q9NQS5 | 7/20 | 0.44 |
| ▸ | PPARG | P37231 | 6/20 | 0.44 |
| ▸ | PPARD | Q03181 | 6/20 | 0.44 |
| ▸ | PPARA | Q07869 | 6/20 | 0.44 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.44 |
| ▸ | TSHR | P16473 | 4/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | TLR2 | O60603 | 2/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.44 |
| ▸ | FABP4 | P15090 | 2/20 | 0.44 |
| ▸ | PTPN1 | P18031 | 2/20 | 0.44 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.44 |
| ▸ | SLC22A8 | Q8TCC7 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.44 |
| ▸ | ESR1 | P03372 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | PDE4A | P27815 | 1/20 | 0.44 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL29200163 | 0.96 | SMPD1 (0.42) | SMPD1CES2FDPSGPR84PPARG | |
| SCHEMBL4154139 | 0.91 | SMPD1 (0.42) | SMPD1CES2FDPSGPR84PPARG | |
| SCHEMBL8683402 | 0.85 | FDPS (0.38) | SMPD1CES2FDPSGPR84PPARG | |
| SCHEMBL3284980 | 0.82 | SMPD1 (0.45) | SMPD1CES2FDPSGPR84PPARG | |
| SCHEMBL658156 | 0.82 | SMPD1 (0.45) | SMPD1CES2FDPSGPR84PPARG | |
| SCHEMBL7619946 | 0.82 | SMPD1 (0.45) | SMPD1CES2FDPSGPR84PPARG | |
| SCHEMBL8772566 | 0.82 | FDPS (0.50) | SMPD1CES2FDPS | |
| SCHEMBL6002240 | 0.82 | SMPD1 (0.45) | SMPD1CES2FDPSGPR84PPARG | |
| SCHEMBL8466412 | 0.82 | SMPD1 (0.45) | SMPD1CES2FDPSGPR84PPARG | |
| SCHEMBL8464966 | 0.82 | SMPD1 (0.45) | SMPD1CES2FDPSGPR84PPARG |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0765306-B1 | ALKYL SULFOACETATE COMPOSITIONS AND METHODS FOR PREPARING SAME | STEPAN CO (US) | 1999-10-20 | — | — | EP | disclosed |
| EP-0765306-A1 | ALKYL SULFOACETATE COMPOSITIONS AND METHODS FOR PREPARING SAME | STEPAN COMPANY (US) | 1997-04-02 | — | — | EP | disclosed |
| US-5616782-A | HEATING ALKYL CHLOROESTER WITH MOLAR EXCESS OF AQUEOUS SULFITE IN PRESENCE OF SULFITATION CATALYST | STEPAN COMPANY (US) | 1997-04-01 | — | — | US | disclosed |
| WO-1995034532-A1 | ALKYL SULFOACETATE COMPOSITIONS AND METHODS FOR PREPARING SAME | STEPAN COMPANY (US) | 1995-12-21 | — | — | WO | disclosed |